N-[2-ethylsulfanyl-4-oxidanylidene-6-(propanoylamino)-1H-pyrimidin-5-yl]benzamide

Systemtic Name: N-[2-ethylsulfanyl-4-oxidanylidene-6-(propanoylamino)-1H-pyrimidin-5-yl]benzamide Openeye Name: N-[2-ethylsulfanyl-4-oxo-6-(propanoylamino)-1H-pyrimidin-5-yl]benzamide CAS Name: N-[2-(ethylthio)-4-oxo-6-(1-oxopropylamino)-1H-pyrimidin-5-yl]benzamide IUPAC Name: N-[2-ethylsulfanyl-4-oxo-6-(propanoylamino)-1H-pyrimidin-5-yl]benzamide Traditional Name: N-[2-(ethylthio)-4-keto-6-propionamido-1H-pyrimidin-5-yl]benzamide Formula: C16H18N4O3S MolecularWeight: 346.40412

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=C(C(=O)N=C(N1)SCC)NC(=O)C2=CC=CC=C2

Isomeric SMILES

CCC(=O)NC1=C(C(=O)N=C(N1)SCC)NC(=O)C2=CC=CC=C2

InChI

InChI=1S/C16H18N4O3S/c1-3-11(21)17-13-12(15(23)20-16(19-13)24-4-2)18-14(22)10-8-6-5-7-9-10/h5-9H,3-4H2,1-2H3,(H,18,22)(H2,17,19,20,21,23)